4-pyrazol-1-yl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide

Systemtic Name: 4-pyrazol-1-yl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Openeye Name: 4-pyrazol-1-yl-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide CAS Name: 4-(1-pyrazolyl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide IUPAC Name: 4-pyrazol-1-yl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Traditional Name: 4-pyrazol-1-yl-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide Formula: C22H15N3OS MolecularWeight: 369.439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N3C=CC=N3)C#CC4=CC=CS4

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N3C=CC=N3)C#CC4=CC=CS4

InChI

InChI=1S/C22H15N3OS/c26-22(18-8-10-20(11-9-18)25-14-3-13-23-25)24-19-5-1-4-17(16-19)7-12-21-6-2-15-27-21/h1-6,8-11,13-16H,(H,24,26)